C25H52NO4.CH3O4S
TL;DR: C25H52NO4.CH3O4S (CAS 28706-44-7) is a chemical compound with molecular formula C26H56NO8S+ and molecular weight 542.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-hydroxyethyl)-methyl-(2-octadecanoyloxyethyl)azanium;methyl hydrogen sulfate
Also Known As: bis(2-hydroxyethyl)-methyl-(2-octadecanoyloxyethyl)ammonium; methyl hydrogen sulfate, (Bis(2-hydroxyethyl))methyl(2-((1-oxooctadecyl)oxy)ethyl)ammonium methyl sulphate, Ethanaminium, N,N-bis(2-hydroxyethyl)-N-methyl-2-((1-oxooctadecyl)oxy)-, methyl sulfate (1:1), Ethanaminium, N,N-bis(2-hydroxyethyl)-N-methyl-2-((1-oxooctadecyl)oxy)-, methyl sulfate (salt), [bis(2-Hydroxyethyl)]methyl[2-[(1-oxooctadecyl)oxy]ethyl]ammonium methyl sulphate
| Molecular Formula | C26H56NO8S+ |
|---|---|
| Molecular Weight | 542.37 g/mol |
| LogP | 4.66 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 25 |
| Exact Mass | 542.3727 |
| Heavy Atoms | 36 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 28706-44-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC[N+](C)(CCO)CCO.COS(=O)(=O)O |
| InChIKey | JTDPANUOJONAEX-UHFFFAOYSA-N |
Product Overview
C25H52NO4.CH3O4S (CAS 28706-44-7), with molecular formula C26H56NO8S+ and molecular weight 542.37 g/mol. IUPAC: bis(2-hydroxyethyl)-methyl-(2-octadecanoyloxyethyl)azanium;methyl hydrogen sulfate.
Chemical Property Profile of C25H52NO4.CH3O4S
Property Insights of C25H52NO4.CH3O4S
The XLogP value of 4.66 indicates that C25H52NO4.CH3O4S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H52NO4.CH3O4S. Following Lipinski's Rule of Five, C25H52NO4.CH3O4S has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C25H52NO4.CH3O4S?
The CAS number of C25H52NO4.CH3O4S is 28706-44-7.
What is the molecular formula of C25H52NO4.CH3O4S?
The molecular formula of C25H52NO4.CH3O4S is C26H56NO8S+.
What is the molecular weight of C25H52NO4.CH3O4S?
The molecular weight of C25H52NO4.CH3O4S is 542.37 g/mol.
Where can I buy C25H52NO4.CH3O4S?
You can request a quote for C25H52NO4.CH3O4S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H52NO4.CH3O4S?
Yes, KEHONG BIO provides custom synthesis services for C25H52NO4.CH3O4S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.